5-nitro-2-(1-thiophen-2-ylpropylamino)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(1-thiophen-2-ylpropylamino)benzenecarbonitrile Openeye Name: 5-nitro-2-[1-(2-thienyl)propylamino]benzonitrile CAS Name: 5-nitro-2-(1-thiophen-2-ylpropylamino)benzonitrile IUPAC Name: 5-nitro-2-(1-thiophen-2-ylpropylamino)benzonitrile Traditional Name: 5-nitro-2-[1-(2-thienyl)propylamino]benzonitrile Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CS1)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CCC(C1=CC=CS1)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C14H13N3O2S/c1-2-12(14-4-3-7-20-14)16-13-6-5-11(17(18)19)8-10(13)9-15/h3-8,12,16H,2H2,1H3